Wafer-Scaled III-Nitrides Nanowire Photocathodes Enabled by Synergistic Dual-Electron Extraction for Efficient Solar-to-Hydrogen Conversion
Corresponding Author: Haiding Sun
Nano-Micro Letters,
Vol. 18 (2026), Article Number: 337
Abstract
Efficient, durable, and scalable photocathodes are indispensable for large-scale solar-to-hydrogen production. Notably, single-junction semiconductor photocathodes are attractive due to their structural simplicity, cost-effectiveness, and mature fabrication, yet they usually exhibit intrinsically poor carrier extraction efficiency. To address this challenge, we propose a synergistic “dual-electron extraction” strategy that fully unleashes the hydrogen evolution potential of single-junction p-InGaN nanowires. Remarkably, the optimized p-InGaN photocathode achieves a photocurrent density of −3.40 mA cm−2 at 0 V vs. RHE—representing a 37.8-fold enhancement over the pristine device—with an onset potential of 0.82 V vs. RHE, while sustaining stable hydrogen generation for over 300 h without additional protective layers. Specifically, an electron-blocking layer was incorporated within p‑InGaN nanowires to suppress electron backflow toward the substrate and promote transport to the nanowire/electrolyte interface. Furthermore, surface anion doping in InGaN nanowires significantly enhances the band bending of InGaN, which promotes interfacial electron transfer while simultaneously optimizing hydrogen adsorption energy, thereby accelerating the hydrogen evolution reaction rate. The proposed synergistic dual-electron extraction strategy markedly improves the electron utilization efficiency of single-junction InGaN nanowires, providing a novel pathway to address the intrinsic limitations of wafer-scale III-V nitride photoelectrodes.
Highlights:
1 A scalable internal–external synergistic dual-electron extraction strategy is proposed, enabling rapid bulk-surface-electrolyte electron transport in single-junction p-InGaN nanowire for highly efficient photoelectrochemical hydrogen evolution.
2 Optimized single-junction p-InGaN photoelectrode exhibits a superior onset potential of 0.82 V vs. RHE and maintains continuous hydrogen generation for more than 300 h without protective coatings.
3 This material platform and optimization strategy possess wafer-scale scalability and manufacturing compatibility, providing new technical insights for photoelectrochemical hydrogen production with industrial application value.
Keywords
Download Citation
Endnote/Zotero/Mendeley (RIS)BibTeX
- P. Zhou, I.A. Navid, Y. Ma, Y. Xiao, P. Wang et al., Solar-to-hydrogen efficiency of more than 9% in photocatalytic water splitting. Nature 613(7942), 66–70 (2023). https://doi.org/10.1038/s41586-022-05399-1
- H. Fu, Y. Wu, Y. Guo, T. Sakurai, Q. Zhang et al., A scalable solar-driven photocatalytic system for separated H2 and O2 production from water. Nat. Commun. 16(1), 990 (2025). https://doi.org/10.1038/s41467-025-56314-x
- Y. Gao, F. Sun, Y. Fang, Y. Wen, F. Hong et al., Molecular photoelectrodes with enhanced photogenerated charge transport for efficient solar hydrogen evolution. J. Am. Chem. Soc. 147(9), 7671–7681 (2025). https://doi.org/10.1021/jacs.4c17133
- Y. Wang, Y. Zhu, L. Zhang, H. Huang, C. Liu et al., Robust tunnel TaOx passivating interlayer enables long-term solar water oxidation. Angew. Chem. Int. Ed. 64(26), e202506326 (2025). https://doi.org/10.1002/anie.202506326
- M.G. Walter, E.L. Warren, J.R. McKone, S.W. Boettcher, Q. Mi et al., Solar water splitting cells. Chem. Rev. 110(11), 6446–6473 (2010). https://doi.org/10.1021/cr1002326
- W.J. Dong, Z. Mi, One-dimensional III-nitrides: towards ultrahigh efficiency, ultrahigh stability artificial photosynthesis. J. Mater. Chem. A 11(11), 5427–5459 (2023). https://doi.org/10.1039/d2ta09967e
- W.J. Dong, Z. Ye, S. Tang, I.A. Navid, Y. Xiao et al., Concentrated solar light photoelectrochemical water splitting for stable and high-yield hydrogen production. Adv. Sci. 11(26), 2309548 (2024). https://doi.org/10.1002/advs.202309548
- W. Chen, D. Wang, W. Wang, X. Liu, Y. Liu et al., Enhanced solar hydrogen production via reconfigured semi-polar facet/cocatalyst heterointerfaces in GaN/Si photocathodes. Nat. Commun. 16, 879 (2025). https://doi.org/10.1038/s41467-024-55743-4
- W. Gu, W. Chen, W. Wang, X. Liu, Z. Gao et al., Highly coupled dynamically modulated electrocatalysts on wafer-scale InGaN/GaN nanowires on silicon for successive acidic photoelectrochemical water oxidation. Adv. Mater. 37(28), 2501218 (2025). https://doi.org/10.1002/adma.202501218
- D. Li, Z. Wu, Y. Li, X. Fan, S.M.N. Hasan et al., A semiconducting hybrid of RhOx/GaN@InGaN for simultaneous activation of methane and water toward syngas by photocatalysis. PNAS Nexus 2(11), pgad347 (2023). https://doi.org/10.1093/pnasnexus/pgad347
- P.G. Moses, C.G. Van de Walle, Band bowing and band alignment in InGaN alloys. Appl. Phys. Lett. 96(2), 021908 (2010). https://doi.org/10.1063/1.3291055
- Y. Wu, X. Liu, A. Pandey, P. Zhou, W.J. Dong et al., III-nitride nanostructures: emerging applications for Micro-LEDs, ultraviolet photonics, quantum optoelectronics, and artificial photosynthesis. Prog. Quantum Electron. 85, 100401 (2022). https://doi.org/10.1016/j.pquantelec.2022.100401
- L. Li, S. Fang, W. Chen, Y. Li, M.F. Vafadar et al., Facile semiconductor p-n homojunction nanowires with strategic p-type doping engineering combined with surface reconstruction for biosensing applications. Nano-Micro Lett. 16(1), 192 (2024). https://doi.org/10.1007/s40820-024-01394-5
- J. Lin, Y. Yu, Z. Zhang, F. Gao, S. Liu et al., A novel approach for achieving high-efficiency photoelectrochemical water oxidation in InGaN nanorods grown on Si system: MXene nanosheets as multifunctional interfacial modifier. Adv. Funct. Mater. 30(13), 1910479 (2020). https://doi.org/10.1002/adfm.201910479
- D. Ghosh, P. Devi, P. Kumar, Modified p-GaN microwells with vertically aligned 2D-MoS2 for enhanced photoelectrochemical water splitting. ACS Appl. Mater. Interfaces 12(12), 13797–13804 (2020). https://doi.org/10.1021/acsami.9b20969
- F.A. Chowdhury, M.L. Trudeau, H. Guo, Z. Mi, A photochemical diode artificial photosynthesis system for unassisted high efficiency overall pure water splitting. Nat. Commun. 9, 1707 (2018). https://doi.org/10.1038/s41467-018-04067-1
- W. Chen, Y. Li, T. Zhang, X. Liu, Z. Gao et al., A quasi solid-state hydrogel/InGaN nanorod heterostructure-enabled amphibious sensor for stable and cross-medium optical sensing and monitoring. ACS Nano 19(28), 26105–26116 (2025). https://doi.org/10.1021/acsnano.5c07003
- W. Chen, D. Wang, X. Liu, Y. Luo, Z. Gao et al., Bioinspired reconfigurable vision sensor based on InGaN semiconductor/hydrogel heterostructure for dynamic-static fusion perception. Adv. Mater. 38(6), e12894 (2026). https://doi.org/10.1002/adma.202512894
- W.J. Dong, J.P. Menzel, Z. Ye, I.A. Navid, P. Zhou et al., Photoelectrochemical urea synthesis from nitrate and carbon dioxide on GaN nanowires. ACS Catal. 14(4), 2588–2596 (2024). https://doi.org/10.1021/acscatal.3c04264
- B. Zhang, P. Zhou, Z. Ye, I.A. Navid, Y. Pan et al., Interfacially coupled Cu-cluster/GaN photocathode for efficient CO2 to ethylene conversion. Nat. Synth. 3(12), 1567–1576 (2024). https://doi.org/10.1038/s44160-024-00648-9
- W.J. Dong, J.P. Menzel, K. Li, Z. Ye, Z. Long et al., Nitrate reduction to ammonia catalyzed by GaN/Si photoelectrodes with metal clusters. Nat. Commun. 16(1), 3383 (2025). https://doi.org/10.1038/s41467-025-58372-7
- K. Peramaiah, V. Ramalingam, H.-C. Fu, M.M. Alsabban, R. Ahmad et al., Optically and electrocatalytically decoupled Si photocathodes with a porous carbon nitride catalyst for nitrogen reduction with over 61.8% faradaic efficiency. Adv. Mater. 33(18), 2100812 (2021). https://doi.org/10.1002/adma.202100812
- J.E. Thorne, S. Li, C. Du, G. Qin, D. Wang, Energetics at the surface of photoelectrodes and its influence on the photoelectrochemical properties. J. Phys. Chem. Lett. 6(20), 4083–4088 (2015). https://doi.org/10.1021/acs.jpclett.5b01372
- P.E. Blöchl, Projector augmented-wave method. Phys. Rev. B 50(24), 17953–17979 (1994). https://doi.org/10.1103/physrevb.50.17953
- J.P. Perdew, A. Ruzsinszky, G.I. Csonka, O.A. Vydrov, G.E. Scuseria et al., Restoring the density-gradient expansion for exchange in solids and surfaces. Phys. Rev. Lett. 100(13), 136406 (2008). https://doi.org/10.1103/physrevlett.100.136406
- J.P. Perdew, K. Burke, M. Ernzerhof, Generalized gradient approximation made simple. Phys. Rev. Lett. 77(18), 3865–3868 (1996). https://doi.org/10.1103/physrevlett.77.3865
- L. Lodeiro, T. Rauch, DensityTool: a post-processing tool for space- and spin-resolved density of states from VASP. Comput. Phys. Commun. 277, 108384 (2022). https://doi.org/10.1016/j.cpc.2022.108384
- J.K. Nørskov, T. Bligaard, A. Logadottir, J.R. Kitchin, J.G. Chen et al., Trends in the exchange current for hydrogen evolution. J. Electrochem. Soc. 152(3), J23 (2005). https://doi.org/10.1149/1.1856988
- J.K. Nørskov, J. Rossmeisl, A. Logadottir, L. Lindqvist, J.R. Kitchin et al., Origin of the overpotential for oxygen reduction at a fuel-cell cathode. J. Phys. Chem. B 108(46), 17886–17892 (2004). https://doi.org/10.1021/jp047349j
- S. Fan, I. Shih, Z. Mi, A monolithically integrated InGaN nanowire/Si tandem photoanode approaching the ideal bandgap configuration of 1.75/1.13 eV. Adv. Energy Mater. 7(2), 1600952 (2017). https://doi.org/10.1002/aenm.201600952
- B. Zhou, J. Li, X. Dong, L. Yao, GaN nanowires/Si photocathodes for CO2 reduction towards solar fuels and chemicals: advances, challenges, and prospects. Sci. China Chem. 66(3), 739–754 (2023). https://doi.org/10.1007/s11426-022-1508-y
- K. Kumakura, T. Makimoto, N. Kobayashi, T. Hashizume, T. Fukui et al., Minority carrier diffusion lengths in MOVPE-grown n- and p-InGaN and performance of AlGaN/InGaN/GaN double heterojunction bipolar transistors. J. Cryst. Growth 298, 787–790 (2007). https://doi.org/10.1016/j.jcrysgro.2006.10.098
- S. Huai, X. Li, P. Li, S. Zhang, X. Huang et al., Rapid charge extraction via hole and electron transfer layers on Cu2O photocathode for stable and efficient photoelectrochemical water reduction. Adv. Sci. 12(40), e09030 (2025). https://doi.org/10.1002/advs.202509030
- X. Liu, F. Liu, J. Yu, G. Xiong, L. Zhao et al., Charge redistribution caused by S, P synergistically active Ru endows an ultrahigh hydrogen evolution activity of S-doped RuP embedded in N, P, S-doped carbon. Adv. Sci. 7(17), 2001526 (2020). https://doi.org/10.1002/advs.202001526
- G. Liang, Z. Li, M. Ishaq, Z. Zheng, Z. Su et al., Charge separation enhancement enables record photocurrent density in Cu2ZnSn(S, Se)4 photocathodes for efficient solar hydrogen production. Adv. Energy Mater. 13(19), 2370076 (2023). https://doi.org/10.1002/aenm.202370076
- T. Lopes, L. Andrade, H.A. Ribeiro, A. Mendes, Characterization of photoelectrochemical cells for water splitting by electrochemical impedance spectroscopy. Int. J. Hydrogen Energy 35(20), 11601–11608 (2010). https://doi.org/10.1016/j.ijhydene.2010.04.001
- S. Ahmed, P.K. Cheng, J. Qiao, W. Gao, A.M. Saleque et al., Nonlinear optical activities in two-dimensional gallium sulfide: a comprehensive study. ACS Nano 16(8), 12390–12402 (2022). https://doi.org/10.1021/acsnano.2c03566
- B. Cao, Q. Liu, Y. Zheng, X. Tang, J. Chai et al., Wafer-scale InN/In2S3 core–shell nanorod array for ultrafast self-powered photodetection. Adv. Funct. Mater. 32(14), 2110715 (2022). https://doi.org/10.1002/adfm.202110715
- E. Papis-Polakowska, J. Kaniewski, J. Jurenczyk, A. Jasik, K. Czuba et al., Surface passivation of (100) GaSb using self-assembled monolayers of long-chain octadecanethiol. AIP Adv. 6(5), 055206 (2016). https://doi.org/10.1063/1.4949754
- J. Chai, Q. Liu, L. Chen, B. Cao, D. Kong et al., Axial InN/InGaN nanorod array heterojunction photodetector with ultrafast speed. Adv. Electron. Mater. 9(3), 2201193 (2023). https://doi.org/10.1002/aelm.202201193
- J. Lin, Z. Zhang, J. Chai, B. Cao, X. Deng et al., Highly efficient InGaN nanorods photoelectrode by constructing Z-scheme charge transfer system for unbiased water splitting. Small 17(3), 2006666 (2021). https://doi.org/10.1002/smll.202006666
- J.W. Chiou, J.C. Jan, H.M. Tsai, W.F. Pong, M.-H. Tsai et al., Electronic structure of GaN nanowire studied by x-ray-absorption spectroscopy and scanning photoelectron microscopy. Appl. Phys. Lett. 82(22), 3949–3951 (2003). https://doi.org/10.1063/1.1579871
- W. Chen, D. Wang, W. Wang, Y. Kang, X. Liu et al., Manipulating surface band bending of III-nitride nanowires with ambipolar charge-transfer characteristics: a pathway toward advanced photoswitching logic gates and encrypted optical communication. Adv. Mater. 36(1), 2470008 (2024). https://doi.org/10.1002/adma.202470008
- J. Cheng, L. Wu, J. Luo, Improving the photovoltage of Cu2O photocathodes with dual buffer layers. Nat. Commun. 14(1), 7228 (2023). https://doi.org/10.1038/s41467-023-42799-x
- M.S. Nasir, Y. Zhao, H. Ye, T. Wang, B. Sheng et al., Efficient hole extraction and *OH alleviation by Pd nanops on GaN nanowires in seawater for solar-driven H2 and H2O2 generation. Angew. Chem. Int. Ed. 64(10), e202420796 (2025). https://doi.org/10.1002/anie.202420796
- J. Li, B. Sheng, Y. Chen, J. Yang, P. Wang et al., Utilizing full-spectrum sunlight for ammonia decomposition to hydrogen over GaN nanowires-supported Ru nanops on silicon. Nat. Commun. 15(1), 7393 (2024). https://doi.org/10.1038/s41467-024-51810-y
- S. Wang, T. He, P. Chen, A. Du, K. Ostrikov et al., In situ formation of oxygen vacancies achieving near-complete charge separation in planar BiVO4 photoanodes. Adv. Mater. 32(26), 2001385 (2020). https://doi.org/10.1002/adma.202001385
- W. Yu, J. Zhang, T. Peng, New insight into the enhanced photocatalytic activity of N-, C- and S-doped ZnO photocatalysts. Appl. Catal. B Environ. 181, 220–227 (2016). https://doi.org/10.1016/j.apcatb.2015.07.031
- C. Lohaus, A. Klein, W. Jaegermann, Limitation of Fermi level shifts by polaron defect states in hematite photoelectrodes. Nat. Commun. 9(1), 4309 (2018). https://doi.org/10.1038/s41467-018-06838-2
- Y. Xiao, X. Kong, S. Vanka, W.J. Dong, G. Zeng et al., Oxynitrides enabled photoelectrochemical water splitting with over 3000 hrs stable operation in practical two-electrode configuration. Nat. Commun. 14(1), 2047 (2023). https://doi.org/10.1038/s41467-023-37754-9
- D. Gao, H. Long, X. Wang, J. Yu, H. Yu, Tailoring antibonding-orbital occupancy state of selenium in Se-enriched ReSe2+x cocatalyst for exceptional H2 evolution of TiO2 photocatalyst. Adv. Funct. Mater. 33(6), 2209994 (2023). https://doi.org/10.1002/adfm.202209994
- S. Fang, L. Li, W. Wang, W. Chen, D. Wang et al., Light-induced bipolar photoresponse with amplified photocurrents in an electrolyte-assisted bipolar p–n junction. Adv. Mater. 35(28), 2300911 (2023). https://doi.org/10.1002/adma.202300911
References
P. Zhou, I.A. Navid, Y. Ma, Y. Xiao, P. Wang et al., Solar-to-hydrogen efficiency of more than 9% in photocatalytic water splitting. Nature 613(7942), 66–70 (2023). https://doi.org/10.1038/s41586-022-05399-1
H. Fu, Y. Wu, Y. Guo, T. Sakurai, Q. Zhang et al., A scalable solar-driven photocatalytic system for separated H2 and O2 production from water. Nat. Commun. 16(1), 990 (2025). https://doi.org/10.1038/s41467-025-56314-x
Y. Gao, F. Sun, Y. Fang, Y. Wen, F. Hong et al., Molecular photoelectrodes with enhanced photogenerated charge transport for efficient solar hydrogen evolution. J. Am. Chem. Soc. 147(9), 7671–7681 (2025). https://doi.org/10.1021/jacs.4c17133
Y. Wang, Y. Zhu, L. Zhang, H. Huang, C. Liu et al., Robust tunnel TaOx passivating interlayer enables long-term solar water oxidation. Angew. Chem. Int. Ed. 64(26), e202506326 (2025). https://doi.org/10.1002/anie.202506326
M.G. Walter, E.L. Warren, J.R. McKone, S.W. Boettcher, Q. Mi et al., Solar water splitting cells. Chem. Rev. 110(11), 6446–6473 (2010). https://doi.org/10.1021/cr1002326
W.J. Dong, Z. Mi, One-dimensional III-nitrides: towards ultrahigh efficiency, ultrahigh stability artificial photosynthesis. J. Mater. Chem. A 11(11), 5427–5459 (2023). https://doi.org/10.1039/d2ta09967e
W.J. Dong, Z. Ye, S. Tang, I.A. Navid, Y. Xiao et al., Concentrated solar light photoelectrochemical water splitting for stable and high-yield hydrogen production. Adv. Sci. 11(26), 2309548 (2024). https://doi.org/10.1002/advs.202309548
W. Chen, D. Wang, W. Wang, X. Liu, Y. Liu et al., Enhanced solar hydrogen production via reconfigured semi-polar facet/cocatalyst heterointerfaces in GaN/Si photocathodes. Nat. Commun. 16, 879 (2025). https://doi.org/10.1038/s41467-024-55743-4
W. Gu, W. Chen, W. Wang, X. Liu, Z. Gao et al., Highly coupled dynamically modulated electrocatalysts on wafer-scale InGaN/GaN nanowires on silicon for successive acidic photoelectrochemical water oxidation. Adv. Mater. 37(28), 2501218 (2025). https://doi.org/10.1002/adma.202501218
D. Li, Z. Wu, Y. Li, X. Fan, S.M.N. Hasan et al., A semiconducting hybrid of RhOx/GaN@InGaN for simultaneous activation of methane and water toward syngas by photocatalysis. PNAS Nexus 2(11), pgad347 (2023). https://doi.org/10.1093/pnasnexus/pgad347
P.G. Moses, C.G. Van de Walle, Band bowing and band alignment in InGaN alloys. Appl. Phys. Lett. 96(2), 021908 (2010). https://doi.org/10.1063/1.3291055
Y. Wu, X. Liu, A. Pandey, P. Zhou, W.J. Dong et al., III-nitride nanostructures: emerging applications for Micro-LEDs, ultraviolet photonics, quantum optoelectronics, and artificial photosynthesis. Prog. Quantum Electron. 85, 100401 (2022). https://doi.org/10.1016/j.pquantelec.2022.100401
L. Li, S. Fang, W. Chen, Y. Li, M.F. Vafadar et al., Facile semiconductor p-n homojunction nanowires with strategic p-type doping engineering combined with surface reconstruction for biosensing applications. Nano-Micro Lett. 16(1), 192 (2024). https://doi.org/10.1007/s40820-024-01394-5
J. Lin, Y. Yu, Z. Zhang, F. Gao, S. Liu et al., A novel approach for achieving high-efficiency photoelectrochemical water oxidation in InGaN nanorods grown on Si system: MXene nanosheets as multifunctional interfacial modifier. Adv. Funct. Mater. 30(13), 1910479 (2020). https://doi.org/10.1002/adfm.201910479
D. Ghosh, P. Devi, P. Kumar, Modified p-GaN microwells with vertically aligned 2D-MoS2 for enhanced photoelectrochemical water splitting. ACS Appl. Mater. Interfaces 12(12), 13797–13804 (2020). https://doi.org/10.1021/acsami.9b20969
F.A. Chowdhury, M.L. Trudeau, H. Guo, Z. Mi, A photochemical diode artificial photosynthesis system for unassisted high efficiency overall pure water splitting. Nat. Commun. 9, 1707 (2018). https://doi.org/10.1038/s41467-018-04067-1
W. Chen, Y. Li, T. Zhang, X. Liu, Z. Gao et al., A quasi solid-state hydrogel/InGaN nanorod heterostructure-enabled amphibious sensor for stable and cross-medium optical sensing and monitoring. ACS Nano 19(28), 26105–26116 (2025). https://doi.org/10.1021/acsnano.5c07003
W. Chen, D. Wang, X. Liu, Y. Luo, Z. Gao et al., Bioinspired reconfigurable vision sensor based on InGaN semiconductor/hydrogel heterostructure for dynamic-static fusion perception. Adv. Mater. 38(6), e12894 (2026). https://doi.org/10.1002/adma.202512894
W.J. Dong, J.P. Menzel, Z. Ye, I.A. Navid, P. Zhou et al., Photoelectrochemical urea synthesis from nitrate and carbon dioxide on GaN nanowires. ACS Catal. 14(4), 2588–2596 (2024). https://doi.org/10.1021/acscatal.3c04264
B. Zhang, P. Zhou, Z. Ye, I.A. Navid, Y. Pan et al., Interfacially coupled Cu-cluster/GaN photocathode for efficient CO2 to ethylene conversion. Nat. Synth. 3(12), 1567–1576 (2024). https://doi.org/10.1038/s44160-024-00648-9
W.J. Dong, J.P. Menzel, K. Li, Z. Ye, Z. Long et al., Nitrate reduction to ammonia catalyzed by GaN/Si photoelectrodes with metal clusters. Nat. Commun. 16(1), 3383 (2025). https://doi.org/10.1038/s41467-025-58372-7
K. Peramaiah, V. Ramalingam, H.-C. Fu, M.M. Alsabban, R. Ahmad et al., Optically and electrocatalytically decoupled Si photocathodes with a porous carbon nitride catalyst for nitrogen reduction with over 61.8% faradaic efficiency. Adv. Mater. 33(18), 2100812 (2021). https://doi.org/10.1002/adma.202100812
J.E. Thorne, S. Li, C. Du, G. Qin, D. Wang, Energetics at the surface of photoelectrodes and its influence on the photoelectrochemical properties. J. Phys. Chem. Lett. 6(20), 4083–4088 (2015). https://doi.org/10.1021/acs.jpclett.5b01372
P.E. Blöchl, Projector augmented-wave method. Phys. Rev. B 50(24), 17953–17979 (1994). https://doi.org/10.1103/physrevb.50.17953
J.P. Perdew, A. Ruzsinszky, G.I. Csonka, O.A. Vydrov, G.E. Scuseria et al., Restoring the density-gradient expansion for exchange in solids and surfaces. Phys. Rev. Lett. 100(13), 136406 (2008). https://doi.org/10.1103/physrevlett.100.136406
J.P. Perdew, K. Burke, M. Ernzerhof, Generalized gradient approximation made simple. Phys. Rev. Lett. 77(18), 3865–3868 (1996). https://doi.org/10.1103/physrevlett.77.3865
L. Lodeiro, T. Rauch, DensityTool: a post-processing tool for space- and spin-resolved density of states from VASP. Comput. Phys. Commun. 277, 108384 (2022). https://doi.org/10.1016/j.cpc.2022.108384
J.K. Nørskov, T. Bligaard, A. Logadottir, J.R. Kitchin, J.G. Chen et al., Trends in the exchange current for hydrogen evolution. J. Electrochem. Soc. 152(3), J23 (2005). https://doi.org/10.1149/1.1856988
J.K. Nørskov, J. Rossmeisl, A. Logadottir, L. Lindqvist, J.R. Kitchin et al., Origin of the overpotential for oxygen reduction at a fuel-cell cathode. J. Phys. Chem. B 108(46), 17886–17892 (2004). https://doi.org/10.1021/jp047349j
S. Fan, I. Shih, Z. Mi, A monolithically integrated InGaN nanowire/Si tandem photoanode approaching the ideal bandgap configuration of 1.75/1.13 eV. Adv. Energy Mater. 7(2), 1600952 (2017). https://doi.org/10.1002/aenm.201600952
B. Zhou, J. Li, X. Dong, L. Yao, GaN nanowires/Si photocathodes for CO2 reduction towards solar fuels and chemicals: advances, challenges, and prospects. Sci. China Chem. 66(3), 739–754 (2023). https://doi.org/10.1007/s11426-022-1508-y
K. Kumakura, T. Makimoto, N. Kobayashi, T. Hashizume, T. Fukui et al., Minority carrier diffusion lengths in MOVPE-grown n- and p-InGaN and performance of AlGaN/InGaN/GaN double heterojunction bipolar transistors. J. Cryst. Growth 298, 787–790 (2007). https://doi.org/10.1016/j.jcrysgro.2006.10.098
S. Huai, X. Li, P. Li, S. Zhang, X. Huang et al., Rapid charge extraction via hole and electron transfer layers on Cu2O photocathode for stable and efficient photoelectrochemical water reduction. Adv. Sci. 12(40), e09030 (2025). https://doi.org/10.1002/advs.202509030
X. Liu, F. Liu, J. Yu, G. Xiong, L. Zhao et al., Charge redistribution caused by S, P synergistically active Ru endows an ultrahigh hydrogen evolution activity of S-doped RuP embedded in N, P, S-doped carbon. Adv. Sci. 7(17), 2001526 (2020). https://doi.org/10.1002/advs.202001526
G. Liang, Z. Li, M. Ishaq, Z. Zheng, Z. Su et al., Charge separation enhancement enables record photocurrent density in Cu2ZnSn(S, Se)4 photocathodes for efficient solar hydrogen production. Adv. Energy Mater. 13(19), 2370076 (2023). https://doi.org/10.1002/aenm.202370076
T. Lopes, L. Andrade, H.A. Ribeiro, A. Mendes, Characterization of photoelectrochemical cells for water splitting by electrochemical impedance spectroscopy. Int. J. Hydrogen Energy 35(20), 11601–11608 (2010). https://doi.org/10.1016/j.ijhydene.2010.04.001
S. Ahmed, P.K. Cheng, J. Qiao, W. Gao, A.M. Saleque et al., Nonlinear optical activities in two-dimensional gallium sulfide: a comprehensive study. ACS Nano 16(8), 12390–12402 (2022). https://doi.org/10.1021/acsnano.2c03566
B. Cao, Q. Liu, Y. Zheng, X. Tang, J. Chai et al., Wafer-scale InN/In2S3 core–shell nanorod array for ultrafast self-powered photodetection. Adv. Funct. Mater. 32(14), 2110715 (2022). https://doi.org/10.1002/adfm.202110715
E. Papis-Polakowska, J. Kaniewski, J. Jurenczyk, A. Jasik, K. Czuba et al., Surface passivation of (100) GaSb using self-assembled monolayers of long-chain octadecanethiol. AIP Adv. 6(5), 055206 (2016). https://doi.org/10.1063/1.4949754
J. Chai, Q. Liu, L. Chen, B. Cao, D. Kong et al., Axial InN/InGaN nanorod array heterojunction photodetector with ultrafast speed. Adv. Electron. Mater. 9(3), 2201193 (2023). https://doi.org/10.1002/aelm.202201193
J. Lin, Z. Zhang, J. Chai, B. Cao, X. Deng et al., Highly efficient InGaN nanorods photoelectrode by constructing Z-scheme charge transfer system for unbiased water splitting. Small 17(3), 2006666 (2021). https://doi.org/10.1002/smll.202006666
J.W. Chiou, J.C. Jan, H.M. Tsai, W.F. Pong, M.-H. Tsai et al., Electronic structure of GaN nanowire studied by x-ray-absorption spectroscopy and scanning photoelectron microscopy. Appl. Phys. Lett. 82(22), 3949–3951 (2003). https://doi.org/10.1063/1.1579871
W. Chen, D. Wang, W. Wang, Y. Kang, X. Liu et al., Manipulating surface band bending of III-nitride nanowires with ambipolar charge-transfer characteristics: a pathway toward advanced photoswitching logic gates and encrypted optical communication. Adv. Mater. 36(1), 2470008 (2024). https://doi.org/10.1002/adma.202470008
J. Cheng, L. Wu, J. Luo, Improving the photovoltage of Cu2O photocathodes with dual buffer layers. Nat. Commun. 14(1), 7228 (2023). https://doi.org/10.1038/s41467-023-42799-x
M.S. Nasir, Y. Zhao, H. Ye, T. Wang, B. Sheng et al., Efficient hole extraction and *OH alleviation by Pd nanops on GaN nanowires in seawater for solar-driven H2 and H2O2 generation. Angew. Chem. Int. Ed. 64(10), e202420796 (2025). https://doi.org/10.1002/anie.202420796
J. Li, B. Sheng, Y. Chen, J. Yang, P. Wang et al., Utilizing full-spectrum sunlight for ammonia decomposition to hydrogen over GaN nanowires-supported Ru nanops on silicon. Nat. Commun. 15(1), 7393 (2024). https://doi.org/10.1038/s41467-024-51810-y
S. Wang, T. He, P. Chen, A. Du, K. Ostrikov et al., In situ formation of oxygen vacancies achieving near-complete charge separation in planar BiVO4 photoanodes. Adv. Mater. 32(26), 2001385 (2020). https://doi.org/10.1002/adma.202001385
W. Yu, J. Zhang, T. Peng, New insight into the enhanced photocatalytic activity of N-, C- and S-doped ZnO photocatalysts. Appl. Catal. B Environ. 181, 220–227 (2016). https://doi.org/10.1016/j.apcatb.2015.07.031
C. Lohaus, A. Klein, W. Jaegermann, Limitation of Fermi level shifts by polaron defect states in hematite photoelectrodes. Nat. Commun. 9(1), 4309 (2018). https://doi.org/10.1038/s41467-018-06838-2
Y. Xiao, X. Kong, S. Vanka, W.J. Dong, G. Zeng et al., Oxynitrides enabled photoelectrochemical water splitting with over 3000 hrs stable operation in practical two-electrode configuration. Nat. Commun. 14(1), 2047 (2023). https://doi.org/10.1038/s41467-023-37754-9
D. Gao, H. Long, X. Wang, J. Yu, H. Yu, Tailoring antibonding-orbital occupancy state of selenium in Se-enriched ReSe2+x cocatalyst for exceptional H2 evolution of TiO2 photocatalyst. Adv. Funct. Mater. 33(6), 2209994 (2023). https://doi.org/10.1002/adfm.202209994
S. Fang, L. Li, W. Wang, W. Chen, D. Wang et al., Light-induced bipolar photoresponse with amplified photocurrents in an electrolyte-assisted bipolar p–n junction. Adv. Mater. 35(28), 2300911 (2023). https://doi.org/10.1002/adma.202300911